SCHEMBL38658245

SCHEMBL38658245

c1ccc2[nH][nH]c3ccccc3ccc2c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA1 P00915 2/20 0.52
▸ CA4 P22748 2/20 0.52
▸ CA6 P23280 2/20 0.52
▸ TRPA1 O75762 1/20 0.52
▸ CA2 P00918 1/20 0.52
▸ ITGB2 P05107 1/20 0.52
▸ ICAM1 P05362 1/20 0.52
▸ ITGAL P20701 1/20 0.52
▸ AHR P35869 1/20 0.52
▸ ADK P55263 1/20 0.52
▸ ALDH1A1 P00352 5/20 0.52
▸ CA12 O43570 1/20 0.52
▸ CA3 P07451 1/20 0.52
▸ CA5A P35218 1/20 0.52
▸ CA7 P43166 1/20 0.52
▸ CA9 Q16790 1/20 0.52
▸ CA13 Q8N1Q1 1/20 0.52
▸ CA14 Q9ULX7 1/20 0.52
▸ CA5B Q9Y2D0 1/20 0.52
▸ CYP2A6 P11509 2/20 0.44

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL9721073 0.78 — —
SCHEMBL30958273 0.69 CA12 (1.00) CA1CA4CA6TRPA1CA2
Indole SCHEMBL1160186 0.69 AHR (1.00) CA1CA4CA6TRPA1CA2
Indole SCHEMBL30463845 0.69 — —
Indole SCHEMBL25404194 0.67 AHR (0.94) CA1CA4CA6TRPA1CA2
Indole SCHEMBL1475229 0.67 AHR (0.94) CA1CA4CA6TRPA1CA2
Indole SCHEMBL22077723 0.67 AHR (0.94) CA1CA4CA6TRPA1CA2
Indole SCHEMBL31198727 0.67 AHR (0.94) CA1CA4CA6TRPA1CA2
Indole SCHEMBL23886438 0.67 AHR (0.94) CA1CA4CA6TRPA1CA2
Indole SCHEMBL1475205 0.67 AHR (0.94) CA1CA4CA6TRPA1CA2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2026101423-A1 PHOTOSWITCHABLE CHEMICAL INDUCED DIMERIZATION SYSTEMS FOR CONTROL OF CELLULAR ACTIVITIES WITH LIGHT WU YAOWEN (SE) 2026-05-15 — — WO disclosed
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